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SMILES: CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nnc(C)o3)c2)CC1

InChI Key: InChIKey=SRWSCJJFUPPXPK-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 481134   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Mast/stem cell growth factor receptor Kit


(Homo sapiens (Human))
BDBM481134
PNG
(US10906896, Cpd 8130)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nnc(C)o3)c2)CC1
Show InChI InChI=1S/C32H33N9O2/c1-21-4-9-27(35-30(42)24-7-5-23(6-8-24)20-41-14-12-40(3)13-15-41)17-29(21)37-32-34-11-10-28(36-32)25-16-26(19-33-18-25)31-39-38-22(2)43-31/h4-11,16-19H,12-15,20H2,1-3H3,(H,35,42)(H,34,36,37)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
44n/an/an/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL1


(Homo sapiens (Human))
BDBM481134
PNG
(US10906896, Cpd 8130)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nnc(C)o3)c2)CC1
Show InChI InChI=1S/C32H33N9O2/c1-21-4-9-27(35-30(42)24-7-5-23(6-8-24)20-41-14-12-40(3)13-15-41)17-29(21)37-32-34-11-10-28(36-32)25-16-26(19-33-18-25)31-39-38-22(2)43-31/h4-11,16-19H,12-15,20H2,1-3H3,(H,35,42)(H,34,36,37)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 323n/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair
Tyrosine-protein kinase ABL2


(Homo sapiens (Human))
BDBM481134
PNG
(US10906896, Cpd 8130)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cncc(c3)-c3nnc(C)o3)c2)CC1
Show InChI InChI=1S/C32H33N9O2/c1-21-4-9-27(35-30(42)24-7-5-23(6-8-24)20-41-14-12-40(3)13-15-41)17-29(21)37-32-34-11-10-28(36-32)25-16-26(19-33-18-25)31-39-38-22(2)43-31/h4-11,16-19H,12-15,20H2,1-3H3,(H,35,42)(H,34,36,37)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 423n/an/an/an/an/an/a



Inhibikase Therapeutics, Inc.

US Patent


Assay Description
Kinase base buffer (50 mM HEPES, pH 7.5 0.0015% Brij-35; 10 mM MgCl2 2 mM DTT) and Stop buffer, (100 mM HEPES, pH 7.5 0.015% Brij-35; 0.2% Coating Re...


US Patent US10906896 (2021)

More data for this
Ligand-Target Pair